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1H-indole-2-carboxylic acid cyclohexylmethyl ester
SpectraBase Compound ID JXL7Wbu16BI
InChI InChI=1S/C16H19NO2/c18-16(19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)17-15/h4-5,8-10,12,17H,1-3,6-7,11H2
InChIKey GJZRDOJKOYIYKL-UHFFFAOYSA-N
Mol Weight 257.33 g/mol
Molecular Formula C16H19NO2
Exact Mass 257.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MTJUvobS7T
Name 1H-indole-2-carboxylic acid cyclohexylmethyl ester
Alternate Name(s) cyclohexylmethyl 1H-indole-2-carboxylate
CAS Registry Number 86328-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO2
InChI InChI=1S/C16H19NO2/c18-16(19-11-12-6-2-1-3-7-12)15-10-13-8-4-5-9-14(13)17-15/h4-5,8-10,12,17H,1-3,6-7,11H2
InChIKey GJZRDOJKOYIYKL-UHFFFAOYSA-N
Molecular Weight 257.333 g/mol
SMILES [nH]1c2ccccc2cc1C(OCC1CCCCC1)=O
SPLASH splash10-06r6-3910000000-8926283eabefe4607f52
Source of Spectrum W5-1989-35132-30404
Wiley ID 1260933